Fasudil Hydrochloride

HCID 163751

기본 정보

CAS
105628-07-7
표준 SMILES
Cl.O=S(=O)(c1cccc2cnccc12)N1CCCNCC1
InChIKey
LFVPBERIVUNMGV-UHFFFAOYSA-N
분자식
C14H18ClN3O2S
평균 분자량
327.8 g/mol
단동위원소 질량
327.0808255

개요

Fasudil hydrochloride is a hydrochloride obtained by reaction of fasudil with one equivalent of hydrochloric acid. It has a role as a vasodilator agent, an antihypertensive agent, a calcium channel blocker, an EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor, a neuroprotective agent and a nootropic agent. It contains a fasudil(1+).

이름 및 식별자

우선 이름
Fasudil Hydrochloride
IUPAC
5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride
영어명
Fasudil hydrochloride
분자식
C14H18ClN3O2S
분자량
327.83

이름 및 동의어

Fasudil hydrochloride105628-07-7Fasudil HClAT 877 hydrochlorideHA 1077 hydrochlorideDTXSID1045615SQ04N8S7BRHexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochlorideDTXCID9025615CHEBI:315931H-1,4-Diazepine, hexahydro-1-(5-isoquinolinylsulfonyl)-, monohydrochlorideRefChem:140012
이름 더 보기
CS-520HA-1077FASUDELCS-1572Fasudil-HAHA-1077 HClCAS:105628-07-7FASUDIL, MONOHCLFasudil (HA-1077)
805-833-0Eril5-((1,4-Diazepan-1-yl)sulfonyl)isoquinoline hydrochlorideMFCD00943198Fasudil (Hydrochloride)Fasudil, Monohydrochloride Salt5-(1,4-diazepan-1-ylsulfonyl)isoquinoline hydrochlorideREGID_for_CID_4917

데이터베이스 식별자

CAS
105628-07-7
PubChem CID
163751
DTXSID
DTXSID1045615
ChEMBL
CHEMBL541388
ChEBI
CHEBI:31593
UNII
SQ04N8S7BR
EC Number
805-833-0

물성

구조 계산 물성

극성 표면적
70.7 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
5
회전 가능 결합 수
2
무거운 원자 수
21

물리화학적 성질

녹는점
220.5 °; · 220.5°; mp 219.3° (Shirotani)
저장 조건
-20 °C · Inert atmosphere,Store in freezer, under -20°C
용해도
2 O: · H2O: >200 mg/mL
물리적 상태
고체
색상
하얀색
수용성
물과 디메틸설폭사이드에 용해됩니다. 에탄올에 불용성.

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk
3
rtecs
HM4031166
독성
LD50 in mice, rats (mg/kg): 67.5, 59.9 i.v.; 124.5, 123.2 s.c.; 273.9, 335.0 orally (Koga)
HS 번호
29339900
risk_code
22
safety_code
36-60

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 3건

A class of drugs that act by selective inhibition of calcium influx through cellular membranes.

Drugs used to cause dilation of the blood vessels.

Agents that inhibit PROTEIN KINASES.

응용 분야 · 1건

개요Fasudil hydrochloride, a novel calcium antagonistic vasodilator, was marketed for the treatment of cerebral vasospasm following subarachnoid hemorrhage (SAH). Fasudil is also a potent inhibitor of myosin light chain kinase and protein kinase C. In contrast to other calcium channel blockers, which regulate the influx of calcium ions through the cell membrane but not involved in the intracellular regulatory mechanism of the calcium, fasudil was suggested to have an intracellular mode of action in relaxing vascular smooth muscle. In patients with neurological deficits due to vasospasm, fasudil decreased the occurrence of angiographic severe and symptomatic vasospasm and cerebral infarction without decreasing systemic blood pressure. Fasudil is reportedly in clinical trials for acute ischemic stroke, sequelae of cerebral vascular diseases and angina pectoris.

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
河北立业化学制品有限公司0310-6697998 13930001710 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

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3건

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